336629
3-(Phenylthio)acrylic acid, mixture of cis and trans
98%
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About This Item
Linear Formula:
C6H5SCH=CHCO2H
CAS Number:
Molecular Weight:
180.22
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
98%
mp
102-106 °C (lit.)
SMILES string
OC(=O)\C=C/Sc1ccccc1
InChI
1S/C9H8O2S/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6-
InChI key
QCLSYKCZWZYPIX-SREVYHEPSA-N
General description
3-(Phenylthio)acrylic acid is also referred as cis-β-phenyl thioacrylic acid. Ionization constants of cis-β-phenyl thioacrylic acid and their ring derivatives have been evaluated.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Transmission of Substituent Effects through Oxygen and Sulfur Atoms. III. The Ionization Equilibrium Constants of Ringsubstituted cis-jS-Phenoxyacrylic Acids.
Kajimoto O, et al.
Bulletin of the Chemical Society of Japan, 46(5), 1425-1428 (1973)
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